4-amino-3-(2-fluoroethoxy)phenol

C8H10FNO2 — CID 154926712

IUPAC4-amino-3-(2-fluoroethoxy)phenol
SMILESNc1ccc(O)cc1OCCF
InChIInChI=1S/C8H10FNO2/c9-3-4-12-8-5-6(11)1-2-7(8)10/h1-2,5,11H,3-4,10H2
InChIKeyDLCNGAIWYHRMFM-UHFFFAOYSA-N
MW171.17 g/mol
LogP1.32
Rot. Bonds3

About 4-amino-3-(2-fluoroethoxy)phenol

4-amino-3-(2-fluoroethoxy)phenol (PubChem CID 154926712) has the molecular formula C8H10FNO2 and a molecular weight of 171.17 g/mol. Its IUPAC name is 4-amino-3-(2-fluoroethoxy)phenol.

Molecular Properties

Compound Name4-amino-3-(2-fluoroethoxy)phenol
PubChem CID154926712
Molecular FormulaC8H10FNO2
Molecular Weight171.17 g/mol
Exact Mass171.07
IUPAC Name4-amino-3-(2-fluoroethoxy)phenol
SMILESNc1ccc(O)cc1OCCF
InChIInChI=1S/C8H10FNO2/c9-3-4-12-8-5-6(11)1-2-7(8)10/h1-2,5,11H,3-4,10H2
InChIKeyDLCNGAIWYHRMFM-UHFFFAOYSA-N
XLogP1.32
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.17
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}, {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Analyze 4-amino-3-(2-fluoroethoxy)phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-(2-fluoroethoxy)phenol?
The IUPAC name of 4-amino-3-(2-fluoroethoxy)phenol (CID 154926712) is 4-amino-3-(2-fluoroethoxy)phenol.
What is the SMILES notation for 4-amino-3-(2-fluoroethoxy)phenol?
The canonical SMILES for 4-amino-3-(2-fluoroethoxy)phenol is Nc1ccc(O)cc1OCCF.
What is the InChIKey of 4-amino-3-(2-fluoroethoxy)phenol?
The InChIKey is DLCNGAIWYHRMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10FNO2/c9-3-4-12-8-5-6(11)1-2-7(8)10/h1-2,5,11H,3-4,10H2.
What are the key properties of 4-amino-3-(2-fluoroethoxy)phenol?
4-amino-3-(2-fluoroethoxy)phenol has a molecular weight of 171.17 g/mol, XLogP of 1.32, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-(2-fluoroethoxy)phenol is sourced from PubChem (CID 154926712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).